N-[[6-[3,5-bis(chloranyl)phenyl]-1H-isoquinolin-2-yl]methyl]-2-methyl-pyrimidin-4-amine

Systemtic Name: N-[[6-[3,5-bis(chloranyl)phenyl]-1H-isoquinolin-2-yl]methyl]-2-methyl-pyrimidin-4-amine Openeye Name: N-[[6-(3,5-dichlorophenyl)-1H-isoquinolin-2-yl]methyl]-2-methyl-pyrimidin-4-amine CAS Name: N-[[6-(3,5-dichlorophenyl)-1H-isoquinolin-2-yl]methyl]-2-methyl-4-pyrimidinamine IUPAC Name: N-[[6-(3,5-dichlorophenyl)-1H-isoquinolin-2-yl]methyl]-2-methylpyrimidin-4-amine Traditional Name: [6-(3,5-dichlorophenyl)-1H-isoquinolin-2-yl]methyl-(2-methylpyrimidin-4-yl)amine Formula: C21H18Cl2N4 MolecularWeight: 397.30042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)NCN2CC3=C(C=C2)C=C(C=C3)C4=CC(=CC(=C4)Cl)Cl

Isomeric SMILES

CC1=NC=CC(=N1)NCN2CC3=C(C=C2)C=C(C=C3)C4=CC(=CC(=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N4/c1-14-24-6-4-21(26-14)25-13-27-7-5-16-8-15(2-3-17(16)12-27)18-9-19(22)11-20(23)10-18/h2-11H,12-13H2,1H3,(H,24,25,26)